5-Amino-1H-pyrazole-3-carboxylic acid - CAS 124004-31-5
Catalog: |
BB005780 |
Product Name: |
5-Amino-1H-pyrazole-3-carboxylic acid |
CAS: |
124004-31-5 |
Synonyms: |
3-amino-1H-pyrazole-5-carboxylic acid |
IUPAC Name: | 3-amino-1H-pyrazole-5-carboxylic acid |
Description: | 5-Amino-1H-pyrazole-3-carboxylic acid (CAS# 124004-31-5) is a reagent used in the preparation of pyrazoles and triazoles as inhibitors of human 15-lipooxygenase-1. |
Molecular Weight: | 127.10 |
Molecular Formula: | C4H5N3O2 |
Canonical SMILES: | C1=C(NN=C1N)C(=O)O |
InChI: | InChI=1S/C4H5N3O2/c5-3-1-2(4(8)9)6-7-3/h1H,(H,8,9)(H3,5,6,7) |
InChI Key: | ICASMSGEUGPHGI-UHFFFAOYSA-N |
Boiling Point: | 561.2 ℃ at 760 mmHg |
Density: | 1.677 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 ℃ |
MDL: | MFCD09263793 |
LogP: | 0.27130 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021228945-A1 | Multi-color urethane golf ball | 20200123 |
US-11013961-B2 | Golf ball | 20190802 |
US-2021031075-A1 | Golf ball | 20190802 |
US-2021031076-A1 | Golf ball | 20190802 |
US-2021322833-A1 | Golf ball | 20190802 |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.038176411 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.038176411 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 92 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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Pyrazoles
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